trimethyl-[2-(12-oxidanylidene-12-phenylmethoxy-dodecanoyl)oxy-3-(11-oxidanylidene-11-phenylmethoxy-undecoxy)propyl]azanium

Systemtic Name: trimethyl-[2-(12-oxidanylidene-12-phenylmethoxy-dodecanoyl)oxy-3-(11-oxidanylidene-11-phenylmethoxy-undecoxy)propyl]azanium Openeye Name: [2-(12-benzyloxy-12-oxo-dodecanoyl)oxy-3-(11-benzyloxy-11-oxo-undecoxy)propyl]-trimethyl-ammonium CAS Name: [2-(1,12-dioxo-12-phenylmethoxydodecoxy)-3-(11-oxo-11-phenylmethoxyundecoxy)propyl]-trimethylammonium IUPAC Name: trimethyl-[2-(12-oxo-12-phenylmethoxydodecanoyl)oxy-3-(11-oxo-11-phenylmethoxyundecoxy)propyl]azanium Traditional Name: [2-(12-benzoxy-12-keto-dodecanoyl)oxy-3-(11-benzoxy-11-keto-undecoxy)propyl]-trimethyl-ammonium Formula: C43H68NO7+ MolecularWeight: 711.00252

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(COCCCCCCCCCCC(=O)OCC1=CC=CC=C1)OC(=O)CCCCCCCCCCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C[N+](C)(C)CC(COCCCCCCCCCCC(=O)OCC1=CC=CC=C1)OC(=O)CCCCCCCCCCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C43H68NO7/c1-44(2,3)34-40(37-48-33-25-15-11-7-6-9-13-23-31-42(46)50-36-39-28-20-17-21-29-39)51-43(47)32-24-14-10-5-4-8-12-22-30-41(45)49-35-38-26-18-16-19-27-38/h16-21,26-29,40H,4-15,22-25,30-37H2,1-3H3/q+1